[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 5-(dimethylsulfamoyl)-2-fluoranyl-benzoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 5-(dimethylsulfamoyl)-2-fluoranyl-benzoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 5-(dimethylsulfamoyl)-2-fluoro-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-fluorobenzoic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 5-(dimethylsulfamoyl)-2-fluorobenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-fluoro-benzoic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C17H23FN2O5S MolecularWeight: 386.438323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC(=O)N2CCCCCC2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC(=O)N2CCCCCC2

InChI

InChI=1S/C17H23FN2O5S/c1-19(2)26(23,24)13-7-8-15(18)14(11-13)17(22)25-12-16(21)20-9-5-3-4-6-10-20/h7-8,11H,3-6,9-10,12H2,1-2H3